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Name | CHEMBL256891 |
---|---|
Molecular formula | C29H31ClN4O2 |
IUPAC name | N-[3-[3-[2-(4-chlorophenyl)-2-oxoethyl]-7-ethyl-2-iminobenzimidazol-1-yl]propyl]-N-methyl-2-phenylacetamide |
Molecular weight | 503.043 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | BDBM50375125 SCHEMBL14373428 |
Inchi Key | NORQBQYXNZJWEB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H31ClN4O2/c1-3-22-11-7-12-25-28(22)33(18-8-17-32(2)27(36)19-21-9-5-4-6-10-21)29(31)34(25)20-26(35)23-13-15-24(30)16-14-23/h4-7,9-16,31H,3,8,17-20H2,1-2H3 |
PubChem CID | 44453232 |
ChEMBL | CHEMBL256891 |
IUPHAR | N/A |
BindingDB | 50375125 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
228532 | C-X-C chemokine receptor type 3 | O88410 | Cxcr3 | Mus musculus (Mouse) | 367 |
228533 | C-X-C chemokine receptor type 3 | P49682 | CXCR3 | Homo sapiens (Human) | 368 |
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